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The Journal of Chemical Physics|September 22, 2022
GPUMD: A package for constructing accurate machine-learned potentials and performing highly efficient atomistic simulationsZheyong Fan, Yanzhou Wang, Penghua Ying, et al.Nature Communications|November 25, 2024
General-purpose machine-learned potential for 16 elemental metals and their alloysKeke Song, Rui Zhao, Jiahui Liu, et al.Pageof 2